SCHEMBL3483787

SCHEMBL3483787

Cn1cnc2c(Oc3ccc(N)cc3Cl)cccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
EGFR P00533 3/20 0.33
ERBB2 P04626 3/20 0.33
ERBB3 P21860 2/20 0.33
ERBB4 Q15303 2/20 0.33
PDE7A Q13946 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
DPP4 P27487 1/20 0.33
BRD4 O60885 1/20 0.32
BRD2 P25440 1/20 0.32
CDK1 P06493 1/20 0.32
PRKCI P41743 1/20 0.32
CYP3A4 P08684 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
AR P10275 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3484323 0.77 RHEB (0.54) MEN1KMT2AEGFRERBB2PRKCI
SCHEMBL3484005 0.74 EGFR (0.51) MEN1KMT2AEGFRERBB2
SCHEMBL23750376 0.74 KMT2A (0.43) MEN1KMT2AEGFRERBB2ERBB3
SCHEMBL31351997 0.74 KMT2A (0.43) MEN1KMT2AEGFRERBB2ERBB3
SCHEMBL9447016 0.73 MEN1 (0.63) MEN1KMT2ANPC1LMNAPKM
SCHEMBL3484623 0.72 PRKCI (0.41) MEN1KMT2AEGFRERBB2ERBB3
SCHEMBL1964539 0.72 CYP3A4 (0.56) MEN1KMT2APDE7ALMNACYP3A4
SCHEMBL7853887 0.71 TLR8 (0.42) NPC1PKMRAB9ADPP4DDB1
SCHEMBL632218 0.70 CYP3A4 (0.46) EGFRERBB2ERBB3ERBB4PDE7A
SCHEMBL4740654 0.70 MEN1 (0.42) MEN1KMT2ANPC1RAB9ADPP4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004238-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
EP-2103620-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-09-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100004238-A1 FUSED HETEROCYCLIC COMPOUND ERBB2, ROS1, FLT3 MEN1 2063/4885KMT2A 300/4885EGFR 13/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.